[cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine

C13H24N2 — CID 106649341

IUPAC[cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine
SMILESCC1(C(NN)C2=CCCCCCC2)CC1
InChIInChI=1S/C13H24N2/c1-13(9-10-13)12(15-14)11-7-5-3-2-4-6-8-11/h7,12,15H,2-6,8-10,14H2,1H3
InChIKeyLAABYNNXYNDVTF-UHFFFAOYSA-N
MW208.35 g/mol
LogP2.90
Rot. Bonds3

About [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine

[cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine (PubChem CID 106649341) has the molecular formula C13H24N2 and a molecular weight of 208.35 g/mol. Its IUPAC name is [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine.

Molecular Properties

Compound Name[cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine
PubChem CID106649341
Molecular FormulaC13H24N2
Molecular Weight208.35 g/mol
Exact Mass208.19
IUPAC Name[cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine
SMILESCC1(C(NN)C2=CCCCCCC2)CC1
InChIInChI=1S/C13H24N2/c1-13(9-10-13)12(15-14)11-7-5-3-2-4-6-8-11/h7,12,15H,2-6,8-10,14H2,1H3
InChIKeyLAABYNNXYNDVTF-UHFFFAOYSA-N
XLogP2.90
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.35
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine?
The IUPAC name of [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine (CID 106649341) is [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine.
What is the SMILES notation for [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine?
The canonical SMILES for [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine is CC1(C(NN)C2=CCCCCCC2)CC1.
What is the InChIKey of [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine?
The InChIKey is LAABYNNXYNDVTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2/c1-13(9-10-13)12(15-14)11-7-5-3-2-4-6-8-11/h7,12,15H,2-6,8-10,14H2,1H3.
What are the key properties of [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine?
[cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine has a molecular weight of 208.35 g/mol, XLogP of 2.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cycloocten-1-yl-(1-methylcyclopropyl)methyl]hydrazine is sourced from PubChem (CID 106649341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).